(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-(3,4-dimethoxyphenyl)acrylamide Formula: C19H15ClN2O5 MolecularWeight: 386.7858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CC3=C(C(=C2)Cl)OCO3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)Cl)OCO3)/C#N)OC

InChI

InChI=1S/C19H15ClN2O5/c1-24-15-4-3-13(8-16(15)25-2)22-19(23)12(9-21)5-11-6-14(20)18-17(7-11)26-10-27-18/h3-8H,10H2,1-2H3,(H,22,23)/b12-5+